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Cas Database |
| Name |
1,2,4-Triazolo[4,3-a]pyridine,6-methyl-3-phenyl- |
EINECS | N/A |
| CAS No. | 4926-15-2 | Density | 1.19 g/cm3 |
| PSA | N/A | LogP | N/A |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C13H11N3 | Boiling Point | N/A |
| Molecular Weight | 209.25 | Flash Point | N/A |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
s-Triazolo[4,3-a]pyridine, 6-methyl-3-phenyl- (7CI,8CI);NSC76007; |
Article Data | 5 |
1,2,4-Triazolo[4,3-a]pyridine,6-methyl-3-phenyl- Specification
This chemical is called 1,2,4-Triazolo[4,3-a]pyridine,6-methyl-3-phenyl-, and its systematic name is 6-Methyl-3-phenyl[1,2,4]triazolo[4,3-a]pyridine. With the molecular formula of C13H11N3, its molecular weight is 209.25. The CAS registry number of this chemical is 4926-15-2.
Other characteristics of the 1,2,4-Triazolo[4,3-a]pyridine,6-methyl-3-phenyl- can be summarised as followings: (1)ACD/LogP: 3.59; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 30.19 Å2; (7)Index of Refraction: 1.657; (8)Molar Refractivity: 64.68 cm3; (9)Molar Volume: 175.6 cm3; (10)Polarizability: 25.64×10-24cm3; (11)Surface Tension: 46.1 dyne/cm; (12)Density: 1.19 g/cm3.
You can still convert the following datas into molecular structure:
1.SMILES: n2nc1ccc(cn1c2c3ccccc3)C
2.InChI: InChI=1/C13H11N3/c1-10-7-8-12-14-15-13(16(12)9-10)11-5-3-2-4-6-11/h2-9H,1H3
3.InChIKey: CMCFBHPRFOHUNM-UHFFFAOYAD
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